(3S)-3-[2-[6-methyl-3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]pentanoylamino]-4-oxidanylidene-5-phenoxy-pentanoic acid

Systemtic Name: (3S)-3-[2-[6-methyl-3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]pentanoylamino]-4-oxidanylidene-5-phenoxy-pentanoic acid Openeye Name: (3S)-3-[2-[6-methyl-3-(naphthalene-2-carbonylamino)-2-oxo-1-pyridyl]pentanoylamino]-4-oxo-5-phenoxy-pentanoic acid CAS Name: (3S)-3-[[2-[6-methyl-3-[[2-naphthalenyl(oxo)methyl]amino]-2-oxo-1-pyridinyl]-1-oxopentyl]amino]-4-oxo-5-phenoxypentanoic acid IUPAC Name: (3S)-3-[2-[6-methyl-3-(naphthalene-2-carbonylamino)-2-oxopyridin-1-yl]pentanoylamino]-4-oxo-5-phenoxypentanoic acid Traditional Name: (3S)-4-keto-3-[2-[2-keto-6-methyl-3-(2-naphthoylamino)-1-pyridyl]pentanoylamino]-5-phenoxy-valeric acid Formula: C33H33N3O7 MolecularWeight: 583.63102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC(CC(=O)O)C(=O)COC1=CC=CC=C1)N2C(=CC=C(C2=O)NC(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCCC(C(=O)N[C@@H](CC(=O)O)C(=O)COC1=CC=CC=C1)N2C(=CC=C(C2=O)NC(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C33H33N3O7/c1-3-9-28(32(41)35-27(19-30(38)39)29(37)20-43-25-12-5-4-6-13-25)36-21(2)14-17-26(33(36)42)34-31(40)24-16-15-22-10-7-8-11-23(22)18-24/h4-8,10-18,27-28H,3,9,19-20H2,1-2H3,(H,34,40)(H,35,41)(H,38,39)/t27-,28?/m0/s1