(2S)-2-benzamido-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-benzamido-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-benzamido-5-[4-(1-naphthyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-benzamido-5-[4-(1-naphthalenyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-benzamido-5-(4-naphthalen-1-ylpiperazin-1-yl)-5-oxopentanoic acid Traditional Name: (2S)-2-benzamido-5-keto-5-[4-(1-naphthyl)piperazino]valeric acid Formula: C26H27N3O4 MolecularWeight: 445.51028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CCC(C(=O)O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC3=CC=CC=C32)C(=O)CC[C@@H](C(=O)O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c30-24(14-13-22(26(32)33)27-25(31)20-8-2-1-3-9-20)29-17-15-28(16-18-29)23-12-6-10-19-7-4-5-11-21(19)23/h1-12,22H,13-18H2,(H,27,31)(H,32,33)/t22-/m0/s1