methyl N-[1-[(5S,6S)-5-azanyl-3,3-dimethyl-6-oxidanyl-7-piperidin-1-yl-heptanoyl]-3,4-dihydro-2H-quinolin-3-yl]carbamate

Systemtic Name: methyl N-[1-[(5S,6S)-5-azanyl-3,3-dimethyl-6-oxidanyl-7-piperidin-1-yl-heptanoyl]-3,4-dihydro-2H-quinolin-3-yl]carbamate Openeye Name: methyl N-[1-[(5S,6S)-5-amino-6-hydroxy-3,3-dimethyl-7-(1-piperidyl)heptanoyl]-3,4-dihydro-2H-quinolin-3-yl]carbamate CAS Name: N-[1-[(5S,6S)-5-amino-6-hydroxy-3,3-dimethyl-1-oxo-7-(1-piperidinyl)heptyl]-3,4-dihydro-2H-quinolin-3-yl]carbamic acid methyl ester IUPAC Name: methyl N-[1-[(5S,6S)-5-amino-6-hydroxy-3,3-dimethyl-7-piperidin-1-ylheptanoyl]-3,4-dihydro-2H-quinolin-3-yl]carbamate Traditional Name: N-[1-[(5S,6S)-5-amino-6-hydroxy-3,3-dimethyl-7-piperidino-heptanoyl]-3,4-dihydro-2H-quinolin-3-yl]carbamic acid methyl ester Formula: C25H40N4O4 MolecularWeight: 460.6095

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(C(CN1CCCCC1)O)N)CC(=O)N2CC(CC3=CC=CC=C32)NC(=O)OC

Isomeric SMILES

CC(C)(C[C@@H]([C@H](CN1CCCCC1)O)N)CC(=O)N2CC(CC3=CC=CC=C32)NC(=O)OC

InChI

InChI=1S/C25H40N4O4/c1-25(2,14-20(26)22(30)17-28-11-7-4-8-12-28)15-23(31)29-16-19(27-24(32)33-3)13-18-9-5-6-10-21(18)29/h5-6,9-10,19-20,22,30H,4,7-8,11-17,26H2,1-3H3,(H,27,32)/t19?,20-,22-/m0/s1