methyl (2R)-2-[[3-(C-ethoxycarbonimidoyl)phenyl]carbonylamino]-3-(1H-indol-2-yl)propanoate

Systemtic Name: methyl (2R)-2-[[3-(C-ethoxycarbonimidoyl)phenyl]carbonylamino]-3-(1H-indol-2-yl)propanoate Openeye Name: methyl (2R)-2-[[3-(ethoxycarbonimidoyl)benzoyl]amino]-3-(1H-indol-2-yl)propanoate CAS Name: (2R)-2-[[[3-[ethoxy(imino)methyl]phenyl]-oxomethyl]amino]-3-(1H-indol-2-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[3-(C-ethoxycarbonimidoyl)benzoyl]amino]-3-(1H-indol-2-yl)propanoate Traditional Name: (2R)-2-[[3-(ethoxycarbonimidoyl)benzoyl]amino]-3-(1H-indol-2-yl)propionic acid methyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)C1=CC(=CC=C1)C(=O)NC(CC2=CC3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CCOC(=N)C1=CC(=CC=C1)C(=O)N[C@H](CC2=CC3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C22H23N3O4/c1-3-29-20(23)15-8-6-9-16(11-15)21(26)25-19(22(27)28-2)13-17-12-14-7-4-5-10-18(14)24-17/h4-12,19,23-24H,3,13H2,1-2H3,(H,25,26)/t19-/m1/s1