9H-fluoren-9-ylmethyl 4-(3-azanylpropanoyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: 9H-fluoren-9-ylmethyl 4-(3-azanylpropanoyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: 9H-fluoren-9-ylmethyl 4-(3-aminopropanoyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-(3-amino-1-oxopropyl)-2-[2-(4-methylanilino)-2-oxoethyl]-1-piperazinecarboxylic acid 9H-fluoren-9-ylmethyl ester IUPAC Name: 9H-fluoren-9-ylmethyl 4-(3-aminopropanoyl)-2-[2-(4-methylanilino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-(3-aminopropanoyl)-2-[2-keto-2-(p-toluidino)ethyl]piperazine-1-carboxylic acid 9H-fluoren-9-ylmethyl ester Formula: C31H34N4O4 MolecularWeight: 526.62606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2CN(CCN2C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)CCN

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2CN(CCN2C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)CCN

InChI

InChI=1S/C31H34N4O4/c1-21-10-12-22(13-11-21)33-29(36)18-23-19-34(30(37)14-15-32)16-17-35(23)31(38)39-20-28-26-8-4-2-6-24(26)25-7-3-5-9-27(25)28/h2-13,23,28H,14-20,32H2,1H3,(H,33,36)