(phenylmethyl) N-[1-[3-(4-azanylbutylamino)propylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[3-(4-azanylbutylamino)propylamino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-[1-[3-(4-aminobutylamino)propylcarbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[1-[3-(4-aminobutylamino)propylamino]-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[3-(4-aminobutylamino)propylamino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[1-[3-(4-aminobutylamino)propylcarbamoyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C21H36N4O3 MolecularWeight: 392.53554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCCCNCCCCN)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(C(=O)NCCCNCCCCN)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H36N4O3/c1-17(2)15-19(20(26)24-14-8-13-23-12-7-6-11-22)25-21(27)28-16-18-9-4-3-5-10-18/h3-5,9-10,17,19,23H,6-8,11-16,22H2,1-2H3,(H,24,26)(H,25,27)