(Z)-6-[3-(naphthalen-1-ylcarbamoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (Z)-6-[3-(naphthalen-1-ylcarbamoylamino)phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (Z)-6-[3-(1-naphthylcarbamoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (Z)-6-[3-[[(1-naphthalenylamino)-oxomethyl]amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (Z)-6-[3-(naphthalen-1-ylcarbamoylamino)phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (Z)-6-[3-(1-naphthylcarbamoylamino)phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C28H25N3O3 MolecularWeight: 451.5164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)NC3=CC=CC(=C3)C(=CCCCC(=O)O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)NC3=CC=CC(=C3)/C(=C/CCCC(=O)O)/C4=CN=CC=C4

InChI

InChI=1S/C28H25N3O3/c32-27(33)16-4-3-13-24(22-11-7-17-29-19-22)21-10-5-12-23(18-21)30-28(34)31-26-15-6-9-20-8-1-2-14-25(20)26/h1-2,5-15,17-19H,3-4,16H2,(H,32,33)(H2,30,31,34)/b24-13-