3-[2-[3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]butanoylamino]-4-oxidanylidene-5-piperazin-1-yl-pentanoic acid

Systemtic Name: 3-[2-[3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]butanoylamino]-4-oxidanylidene-5-piperazin-1-yl-pentanoic acid Openeye Name: 3-[2-[3-(naphthalene-2-carbonylamino)-2-oxo-1-pyridyl]butanoylamino]-4-oxo-5-piperazin-1-yl-pentanoic acid CAS Name: 3-[[2-[3-[[2-naphthalenyl(oxo)methyl]amino]-2-oxo-1-pyridinyl]-1-oxobutyl]amino]-4-oxo-5-(1-piperazinyl)pentanoic acid IUPAC Name: 3-[2-[3-(naphthalene-2-carbonylamino)-2-oxopyridin-1-yl]butanoylamino]-4-oxo-5-piperazin-1-ylpentanoic acid Traditional Name: 4-keto-3-[2-[2-keto-3-(2-naphthoylamino)-1-pyridyl]butanoylamino]-5-piperazino-valeric acid Formula: C29H33N5O6 MolecularWeight: 547.60222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(CC(=O)O)C(=O)CN1CCNCC1)N2C=CC=C(C2=O)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCC(C(=O)NC(CC(=O)O)C(=O)CN1CCNCC1)N2C=CC=C(C2=O)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H33N5O6/c1-2-24(28(39)32-23(17-26(36)37)25(35)18-33-14-11-30-12-15-33)34-13-5-8-22(29(34)40)31-27(38)21-10-9-19-6-3-4-7-20(19)16-21/h3-10,13,16,23-24,30H,2,11-12,14-15,17-18H2,1H3,(H,31,38)(H,32,39)(H,36,37)