[2-hydroxyethyl(phenylmethoxycarbonyl)amino]methyl 3-pyrrol-1-ylbenzoate

Systemtic Name: [2-hydroxyethyl(phenylmethoxycarbonyl)amino]methyl 3-pyrrol-1-ylbenzoate Openeye Name: [benzyloxycarbonyl(2-hydroxyethyl)amino]methyl 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid [2-hydroxyethyl(phenylmethoxycarbonyl)amino]methyl ester IUPAC Name: [2-hydroxyethyl(phenylmethoxycarbonyl)amino]methyl 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid [carbobenzoxy(2-hydroxyethyl)amino]methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CCO)COC(=O)C2=CC(=CC=C2)N3C=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CCO)COC(=O)C2=CC(=CC=C2)N3C=CC=C3

InChI

InChI=1S/C22H22N2O5/c25-14-13-24(22(27)28-16-18-7-2-1-3-8-18)17-29-21(26)19-9-6-10-20(15-19)23-11-4-5-12-23/h1-12,15,25H,13-14,16-17H2