N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]-4-ethoxy-benzamide

Systemtic Name: N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]-4-ethoxy-benzamide Openeye Name: N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]-4-ethoxy-benzamide CAS Name: N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methylpropyl]-4-ethoxybenzamide IUPAC Name: N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methylpropyl]-4-ethoxybenzamide Traditional Name: N-[2-[4-(dimethylamino)-6-isocyano-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]-4-ethoxy-benzamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(C)(C)C2CC(C3=C(N2)C=CC(=C3)[N+]#[C-])N(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(C)(C)C2CC(C3=C(N2)C=CC(=C3)[N+]#[C-])N(C)C

InChI

InChI=1S/C25H32N4O2/c1-7-31-19-11-8-17(9-12-19)24(30)27-16-25(2,3)23-15-22(29(5)6)20-14-18(26-4)10-13-21(20)28-23/h8-14,22-23,28H,7,15-16H2,1-3,5-6H3,(H,27,30)