6-[2-[(2-azanyl-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[2-[(2-azanyl-2-oxidanylidene-ethyl)-(phenylmethyl)amino]-1-oxidanyl-2-oxidanylidene-ethyl]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[2-[(2-amino-2-oxo-ethyl)-benzyl-amino]-1-hydroxy-2-oxo-ethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[2-[(2-amino-2-oxoethyl)-(phenylmethyl)amino]-1-hydroxy-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[2-[(2-amino-2-oxoethyl)-benzylamino]-1-hydroxy-2-oxoethyl]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[2-[(2-amino-2-keto-ethyl)-benzyl-amino]-1-hydroxy-2-keto-ethyl]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C19H23N3O6S MolecularWeight: 421.46742

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(CC3=CC=CC=C3)CC(=O)N)O)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)C(C(=O)N(CC3=CC=CC=C3)CC(=O)N)O)C(=O)O)C

InChI

InChI=1S/C19H23N3O6S/c1-19(2)14(18(27)28)22-15(25)12(17(22)29-19)13(24)16(26)21(9-11(20)23)8-10-6-4-3-5-7-10/h3-7,12-14,17,24H,8-9H2,1-2H3,(H2,20,23)(H,27,28)