2-azanyl-N-[4-azanyl-1-(4-hydroxyphenyl)-5-methyl-3-oxidanylidene-4-[(E)-undecoxyiminomethyl]heptan-2-yl]-3-methyl-butanamide hydrochloride

Systemtic Name: 2-azanyl-N-[4-azanyl-1-(4-hydroxyphenyl)-5-methyl-3-oxidanylidene-4-[(E)-undecoxyiminomethyl]heptan-2-yl]-3-methyl-butanamide hydrochloride Openeye Name: 2-amino-N-[3-amino-1-[(4-hydroxyphenyl)methyl]-4-methyl-2-oxo-3-[(E)-undecoxyiminomethyl]hexyl]-3-methyl-butanamide hydrochloride CAS Name: 2-amino-N-[4-amino-1-(4-hydroxyphenyl)-5-methyl-3-oxo-4-[(E)-undecoxyiminomethyl]heptan-2-yl]-3-methylbutanamide hydrochloride IUPAC Name: 2-amino-N-[4-amino-1-(4-hydroxyphenyl)-5-methyl-3-oxo-4-[(E)-undecoxyiminomethyl]heptan-2-yl]-3-methylbutanamide hydrochloride Traditional Name: 2-amino-N-[3-amino-1-(4-hydroxybenzyl)-2-keto-4-methyl-3-[(E)-undecyloximinomethyl]hexyl]-3-methyl-butyramide hydrochloride Formula: C31H55ClN4O4 MolecularWeight: 583.2458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCON=CC(C(C)CC)(C(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(C(C)C)N)N.Cl

Isomeric SMILES

CCCCCCCCCCCO/N=C/C(C(C)CC)(C(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(C(C)C)N)N.Cl

InChI

InChI=1S/C31H54N4O4.ClH/c1-6-8-9-10-11-12-13-14-15-20-39-34-22-31(33,24(5)7-2)29(37)27(35-30(38)28(32)23(3)4)21-25-16-18-26(36)19-17-25;/h16-19,22-24,27-28,36H,6-15,20-21,32-33H2,1-5H3,(H,35,38);1H/b34-22+;