3-methylbutyl N-[4-(3,4-dihydro-2H-pyrrol-5-ylamino)-3-methyl-phenyl]carbamate

Systemtic Name: 3-methylbutyl N-[4-(3,4-dihydro-2H-pyrrol-5-ylamino)-3-methyl-phenyl]carbamate Openeye Name: isopentyl N-[4-(3,4-dihydro-2H-pyrrol-5-ylamino)-3-methyl-phenyl]carbamate CAS Name: N-[4-(3,4-dihydro-2H-pyrrol-5-ylamino)-3-methylphenyl]carbamic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl N-[4-(3,4-dihydro-2H-pyrrol-5-ylamino)-3-methylphenyl]carbamate Traditional Name: N-[3-methyl-4-(1-pyrrolin-2-ylamino)phenyl]carbamic acid isoamyl ester Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)OCCC(C)C)NC2=NCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)OCCC(C)C)NC2=NCCC2

InChI

InChI=1S/C17H25N3O2/c1-12(2)8-10-22-17(21)19-14-6-7-15(13(3)11-14)20-16-5-4-9-18-16/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,18,20)(H,19,21)