[4-[(2-azanyl-4-methyl-pentanoyl)amino]-3-methyl-3-oxidanyl-butyl]-(azepan-1-ylmethyl)carbamic acid

Systemtic Name: [4-[(2-azanyl-4-methyl-pentanoyl)amino]-3-methyl-3-oxidanyl-butyl]-(azepan-1-ylmethyl)carbamic acid Openeye Name: [4-[(2-amino-4-methyl-pentanoyl)amino]-3-hydroxy-3-methyl-butyl]-(azepan-1-ylmethyl)carbamic acid CAS Name: [4-[(2-amino-4-methyl-1-oxopentyl)amino]-3-hydroxy-3-methylbutyl]-(1-azepanylmethyl)carbamic acid IUPAC Name: [4-[(2-amino-4-methylpentanoyl)amino]-3-hydroxy-3-methylbutyl]-(azepan-1-ylmethyl)carbamic acid Traditional Name: [4-[(2-amino-4-methyl-pentanoyl)amino]-3-hydroxy-3-methyl-butyl]-(azepan-1-ylmethyl)carbamic acid Formula: C19H38N4O4 MolecularWeight: 386.52942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(C)(CCN(CN1CCCCCC1)C(=O)O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NCC(C)(CCN(CN1CCCCCC1)C(=O)O)O)N

InChI

InChI=1S/C19H38N4O4/c1-15(2)12-16(20)17(24)21-13-19(3,27)8-11-23(18(25)26)14-22-9-6-4-5-7-10-22/h15-16,27H,4-14,20H2,1-3H3,(H,21,24)(H,25,26)