[(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylpropanoate

Systemtic Name: [(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxidanylidene-propan-2-yl] 3-phenylpropanoate Openeye Name: [(1S)-2-[(9-ethylcarbazol-3-yl)amino]-1-methyl-2-oxo-ethyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [(2S)-1-[(9-ethyl-3-carbazolyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [(1S)-2-[(9-ethylcarbazol-3-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C26H26N2O3 MolecularWeight: 414.49624

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)OC(=O)CCC3=CC=CC=C3)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)[C@H](C)OC(=O)CCC3=CC=CC=C3)C4=CC=CC=C41

InChI

InChI=1S/C26H26N2O3/c1-3-28-23-12-8-7-11-21(23)22-17-20(14-15-24(22)28)27-26(30)18(2)31-25(29)16-13-19-9-5-4-6-10-19/h4-12,14-15,17-18H,3,13,16H2,1-2H3,(H,27,30)/t18-/m0/s1