5-azanyl-2-[(2-azanyl-3-naphthalen-2-yl-propanoyl)-methyl-amino]-N-[2-(4-hydroxyphenyl)ethyl]pentanamide

Systemtic Name: 5-azanyl-2-[(2-azanyl-3-naphthalen-2-yl-propanoyl)-methyl-amino]-N-[2-(4-hydroxyphenyl)ethyl]pentanamide Openeye Name: 5-amino-2-[[2-amino-3-(2-naphthyl)propanoyl]-methyl-amino]-N-[2-(4-hydroxyphenyl)ethyl]pentanamide CAS Name: 5-amino-2-[[2-amino-3-(2-naphthalenyl)-1-oxopropyl]-methylamino]-N-[2-(4-hydroxyphenyl)ethyl]pentanamide IUPAC Name: 5-amino-2-[(2-amino-3-naphthalen-2-ylpropanoyl)-methylamino]-N-[2-(4-hydroxyphenyl)ethyl]pentanamide Traditional Name: 5-amino-2-[[2-amino-3-(2-naphthyl)propanoyl]-methyl-amino]-N-[2-(4-hydroxyphenyl)ethyl]valeramide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCCN)C(=O)NCCC1=CC=C(C=C1)O)C(=O)C(CC2=CC3=CC=CC=C3C=C2)N

Isomeric SMILES

CN(C(CCCN)C(=O)NCCC1=CC=C(C=C1)O)C(=O)C(CC2=CC3=CC=CC=C3C=C2)N

InChI

InChI=1S/C27H34N4O3/c1-31(27(34)24(29)18-20-8-11-21-5-2-3-6-22(21)17-20)25(7-4-15-28)26(33)30-16-14-19-9-12-23(32)13-10-19/h2-3,5-6,8-13,17,24-25,32H,4,7,14-16,18,28-29H2,1H3,(H,30,33)