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

Systemtic Name: (3S)-3-[2-[3-(naphthalen-2-ylcarbonylamino)-2-oxidanylidene-pyridin-1-yl]propanoylamino]-4-oxidanylidene-5-phenoxy-pentanoic acid Openeye Name: (3S)-3-[2-[3-(naphthalene-2-carbonylamino)-2-oxo-1-pyridyl]propanoylamino]-4-oxo-5-phenoxy-pentanoic acid CAS Name: (3S)-3-[[2-[3-[[2-naphthalenyl(oxo)methyl]amino]-2-oxo-1-pyridinyl]-1-oxopropyl]amino]-4-oxo-5-phenoxypentanoic acid IUPAC Name: (3S)-3-[2-[3-(naphthalene-2-carbonylamino)-2-oxopyridin-1-yl]propanoylamino]-4-oxo-5-phenoxypentanoic acid Traditional Name: (3S)-4-keto-3-[2-[2-keto-3-(2-naphthoylamino)-1-pyridyl]propanoylamino]-5-phenoxy-valeric acid Formula: C30H27N3O7 MolecularWeight: 541.55128

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Descriptors Computed from Structure

Canonical SMILES:

CC(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

Isomeric SMILES

CC(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

InChI

InChI=1S/C30H27N3O7/c1-19(28(37)32-25(17-27(35)36)26(34)18-40-23-10-3-2-4-11-23)33-15-7-12-24(30(33)39)31-29(38)22-14-13-20-8-5-6-9-21(20)16-22/h2-16,19,25H,17-18H2,1H3,(H,31,38)(H,32,37)(H,35,36)/t19?,25-/m0/s1