2-[3-[(Z)-C-aminocarbonyl-N-methoxy-carbonimidoyl]-2-ethyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[3-[(Z)-C-aminocarbonyl-N-methoxy-carbonimidoyl]-2-ethyl-1-(phenylmethyl)indol-4-yl]oxyethanoic acid Openeye Name: 2-[1-benzyl-3-[(Z)-C-carbamoyl-N-methoxy-carbonimidoyl]-2-ethyl-indol-4-yl]oxyacetic acid CAS Name: 2-[[3-[(1Z)-2-amino-1-methoxyimino-2-oxoethyl]-2-ethyl-1-(phenylmethyl)-4-indolyl]oxy]acetic acid IUPAC Name: 2-[1-benzyl-3-[(Z)-C-carbamoyl-N-methoxycarbonimidoyl]-2-ethylindol-4-yl]oxyacetic acid Traditional Name: 2-[1-benzyl-3-[(Z)-C-carbamoyl-N-methoxy-carbonimidoyl]-2-ethyl-indol-4-yl]oxyacetic acid Formula: C22H23N3O5 MolecularWeight: 409.43512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)O)C(=NOC)C(=O)N

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC=C2OCC(=O)O)/C(=N/OC)/C(=O)N

InChI

InChI=1S/C22H23N3O5/c1-3-15-20(21(22(23)28)24-29-2)19-16(10-7-11-17(19)30-13-18(26)27)25(15)12-14-8-5-4-6-9-14/h4-11H,3,12-13H2,1-2H3,(H2,23,28)(H,26,27)/b24-21-