(phenylmethyl) N-[1-[2-azanyl-1-(4-methylpentyl)-3-oxidanyl-piperidin-2-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-azanyl-1-(4-methylpentyl)-3-oxidanyl-piperidin-2-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-(2-amino-3-hydroxy-1-isohexyl-piperidine-2-carbonyl)-3-methyl-butyl]carbamate CAS Name: N-[1-[2-amino-3-hydroxy-1-(4-methylpentyl)-2-piperidinyl]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-amino-3-hydroxy-1-(4-methylpentyl)piperidin-2-yl]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-(2-amino-3-hydroxy-1-isohexyl-pipecoloyl)-3-methyl-butyl]carbamic acid benzyl ester Formula: C25H41N3O4 MolecularWeight: 447.61074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1CCCC(C1(C(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)N)O

Isomeric SMILES

CC(C)CCCN1CCCC(C1(C(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2)N)O

InChI

InChI=1S/C25H41N3O4/c1-18(2)10-8-14-28-15-9-13-22(29)25(28,26)23(30)21(16-19(3)4)27-24(31)32-17-20-11-6-5-7-12-20/h5-7,11-12,18-19,21-22,29H,8-10,13-17,26H2,1-4H3,(H,27,31)