2-[3-azanyl-1-(2-methoxyethanoyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid

Systemtic Name: 2-[3-azanyl-1-(2-methoxyethanoyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl]ethanoic acid Openeye Name: 2-[3-amino-1-(2-methoxyacetyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid CAS Name: 2-[3-amino-1-(2-methoxy-1-oxoethyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid IUPAC Name: 2-[3-amino-1-(2-methoxyacetyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Traditional Name: 2-[3-amino-4-keto-1-(2-methoxyacetyl)-2,3-dihydro-1,5-benzodiazepin-5-yl]acetic acid Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)N

Isomeric SMILES

COCC(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)O)N

InChI

InChI=1S/C14H17N3O5/c1-22-8-12(18)16-6-9(15)14(21)17(7-13(19)20)11-5-3-2-4-10(11)16/h2-5,9H,6-8,15H2,1H3,(H,19,20)