1-[(2S)-2-azanyl-4-methyl-pentanoyl]-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[(2S)-2-azanyl-4-methyl-pentanoyl]-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-[(2S)-2-amino-4-methyl-pentanoyl]-N-[(1S)-2-[(2-methoxyphenyl)methylamino]-1-methyl-2-oxo-ethyl]piperidine-4-carboxamide CAS Name: 1-[(2S)-2-amino-4-methyl-1-oxopentyl]-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-[(2S)-2-amino-4-methylpentanoyl]-N-[(2S)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: 1-[(2S)-2-amino-4-methyl-pentanoyl]-N-[(1S)-2-keto-1-methyl-2-(o-anisylamino)ethyl]isonipecotamide Formula: C23H36N4O4 MolecularWeight: 432.55634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCC(CC1)C(=O)NC(C)C(=O)NCC2=CC=CC=C2OC)N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1OC)NC(=O)C2CCN(CC2)C(=O)[C@H](CC(C)C)N

InChI

InChI=1S/C23H36N4O4/c1-15(2)13-19(24)23(30)27-11-9-17(10-12-27)22(29)26-16(3)21(28)25-14-18-7-5-6-8-20(18)31-4/h5-8,15-17,19H,9-14,24H2,1-4H3,(H,25,28)(H,26,29)/t16-,19-/m0/s1