N-[(2S)-6-azanyl-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxidanylidene-hexan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[(2S)-6-azanyl-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxidanylidene-hexan-2-yl]-2-methoxy-benzamide Openeye Name: N-[(1S)-5-amino-1-[(2S)-2-cyanopyrrolidine-1-carbonyl]pentyl]-2-methoxy-benzamide CAS Name: N-[(2S)-6-amino-1-[(2S)-2-cyano-1-pyrrolidinyl]-1-oxohexan-2-yl]-2-methoxybenzamide IUPAC Name: N-[(2S)-6-amino-1-[(2S)-2-cyanopyrrolidin-1-yl]-1-oxohexan-2-yl]-2-methoxybenzamide Traditional Name: N-[(1S)-5-amino-1-[(2S)-2-cyanopyrrolidine-1-carbonyl]pentyl]-2-methoxy-benzamide Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCCCN)C(=O)N2CCCC2C#N

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C#N

InChI

InChI=1S/C19H26N4O3/c1-26-17-10-3-2-8-15(17)18(24)22-16(9-4-5-11-20)19(25)23-12-6-7-14(23)13-21/h2-3,8,10,14,16H,4-7,9,11-12,20H2,1H3,(H,22,24)/t14-,16-/m0/s1