(phenylmethyl) N-[5-(aminomethyl)-10-azanyl-2-methyl-4-oxidanylidene-6-(phenylmethyl)decan-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[5-(aminomethyl)-10-azanyl-2-methyl-4-oxidanylidene-6-(phenylmethyl)decan-3-yl]carbamate Openeye Name: benzyl N-[8-amino-3-(aminomethyl)-4-benzyl-1-isopropyl-2-oxo-octyl]carbamate CAS Name: N-[10-amino-5-(aminomethyl)-2-methyl-4-oxo-6-(phenylmethyl)decan-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[10-amino-5-(aminomethyl)-6-benzyl-2-methyl-4-oxodecan-3-yl]carbamate Traditional Name: N-[8-amino-3-(aminomethyl)-4-benzyl-1-isopropyl-2-keto-octyl]carbamic acid benzyl ester Formula: C27H39N3O3 MolecularWeight: 453.61686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(CN)C(CCCCN)CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)C(CN)C(CCCCN)CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C27H39N3O3/c1-20(2)25(30-27(32)33-19-22-13-7-4-8-14-22)26(31)24(18-29)23(15-9-10-16-28)17-21-11-5-3-6-12-21/h3-8,11-14,20,23-25H,9-10,15-19,28-29H2,1-2H3,(H,30,32)