N-butyl-4-[[2-[2-(5-methoxy-2-methyl-phenyl)ethanoylamino]-3-methyl-butanoyl]amino]-6-methyl-3-oxidanyl-heptanamide

Systemtic Name: N-butyl-4-[[2-[2-(5-methoxy-2-methyl-phenyl)ethanoylamino]-3-methyl-butanoyl]amino]-6-methyl-3-oxidanyl-heptanamide Openeye Name: N-butyl-3-hydroxy-4-[[2-[[2-(5-methoxy-2-methyl-phenyl)acetyl]amino]-3-methyl-butanoyl]amino]-6-methyl-heptanamide CAS Name: N-butyl-3-hydroxy-4-[[2-[[2-(5-methoxy-2-methylphenyl)-1-oxoethyl]amino]-3-methyl-1-oxobutyl]amino]-6-methylheptanamide IUPAC Name: N-butyl-3-hydroxy-4-[[2-[[2-(5-methoxy-2-methylphenyl)acetyl]amino]-3-methylbutanoyl]amino]-6-methylheptanamide Traditional Name: N-butyl-3-hydroxy-4-[[2-[[2-(5-methoxy-2-methyl-phenyl)acetyl]amino]-3-methyl-butanoyl]amino]-6-methyl-enanthamide Formula: C27H45N3O5 MolecularWeight: 491.6633

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)CC1=C(C=CC(=C1)OC)C)O

Isomeric SMILES

CCCCNC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)CC1=C(C=CC(=C1)OC)C)O

InChI

InChI=1S/C27H45N3O5/c1-8-9-12-28-24(32)16-23(31)22(13-17(2)3)29-27(34)26(18(4)5)30-25(33)15-20-14-21(35-7)11-10-19(20)6/h10-11,14,17-18,22-23,26,31H,8-9,12-13,15-16H2,1-7H3,(H,28,32)(H,29,34)(H,30,33)