3-(1H-indol-3-yl)-2-[(2-naphthalen-2-yl-3-oxidanyl-heptanoyl)amino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[(2-naphthalen-2-yl-3-oxidanyl-heptanoyl)amino]propanoic acid Openeye Name: 2-[[3-hydroxy-2-(2-naphthyl)heptanoyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[3-hydroxy-2-(2-naphthalenyl)-1-oxoheptyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(3-hydroxy-2-naphthalen-2-ylheptanoyl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[[3-hydroxy-2-(2-naphthyl)heptanoyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C1=CC2=CC=CC=C2C=C1)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O)O

Isomeric SMILES

CCCCC(C(C1=CC2=CC=CC=C2C=C1)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O)O

InChI

InChI=1S/C28H30N2O4/c1-2-3-12-25(31)26(20-14-13-18-8-4-5-9-19(18)15-20)27(32)30-24(28(33)34)16-21-17-29-23-11-7-6-10-22(21)23/h4-11,13-15,17,24-26,29,31H,2-3,12,16H2,1H3,(H,30,32)(H,33,34)