[(1R)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-[(aminocarbonylamino)methyl]benzoate

Systemtic Name: [(1R)-2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] 4-[(aminocarbonylamino)methyl]benzoate Openeye Name: [(1R)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl] 4-(ureidomethyl)benzoate CAS Name: 4-[(carbamoylamino)methyl]benzoic acid [(1R)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(7-ethyl-1H-indol-3-yl)-2-oxo-1-phenylethyl] 4-[(carbamoylamino)methyl]benzoate Traditional Name: 4-(ureidomethyl)benzoic acid [(1R)-2-(7-ethyl-1H-indol-3-yl)-2-keto-1-phenyl-ethyl] ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)CNC(=O)N

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)[C@@H](C3=CC=CC=C3)OC(=O)C4=CC=C(C=C4)CNC(=O)N

InChI

InChI=1S/C27H25N3O4/c1-2-18-9-6-10-21-22(16-29-23(18)21)24(31)25(19-7-4-3-5-8-19)34-26(32)20-13-11-17(12-14-20)15-30-27(28)33/h3-14,16,25,29H,2,15H2,1H3,(H3,28,30,33)/t25-/m1/s1