1-[2-[(4-azanylpyrrolidin-2-yl)methylamino]-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde

Systemtic Name: 1-[2-[(4-azanylpyrrolidin-2-yl)methylamino]-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Openeye Name: 1-[2-[(4-aminopyrrolidin-2-yl)methylamino]-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde CAS Name: 1-[2-[(4-amino-2-pyrrolidinyl)methylamino]-3,3-dimethyl-1-oxobutyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxaldehyde IUPAC Name: 1-[2-[(4-aminopyrrolidin-2-yl)methylamino]-3,3-dimethylbutanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Traditional Name: 1-[2-[(4-aminopyrrolidin-2-yl)methylamino]-3,3-dimethyl-butanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NCC3CC(CN3)N

Isomeric SMILES

CC(C)(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NCC3CC(CN3)N

InChI

InChI=1S/C21H32N4O2/c1-21(2,3)20(24-11-15-9-14(22)10-23-15)19(27)18-17-7-5-4-6-13(17)8-16(12-26)25-18/h4-7,12,14-16,18,20,23-25H,8-11,22H2,1-3H3