4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[3-(6-methylpyridin-3-yl)oxypropyl]piperidin-4-yl]benzamide hydrate

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[3-methoxy-1-[3-(6-methylpyridin-3-yl)oxypropyl]piperidin-4-yl]benzamide hydrate Openeye Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-[(6-methyl-3-pyridyl)oxy]propyl]-4-piperidyl]benzamide hydrate CAS Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-[(6-methyl-3-pyridinyl)oxy]propyl]-4-piperidinyl]benzamide hydrate IUPAC Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-(6-methylpyridin-3-yl)oxypropyl]piperidin-4-yl]benzamide hydrate Traditional Name: 4-amino-5-chloro-2-methoxy-N-[3-methoxy-1-[3-[(6-methyl-3-pyridyl)oxy]propyl]-4-piperidyl]benzamide hydrate Formula: C23H33ClN4O5 MolecularWeight: 480.98492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)OCCCN2CCC(C(C2)OC)NC(=O)C3=CC(=C(C=C3OC)N)Cl.O

Isomeric SMILES

CC1=NC=C(C=C1)OCCCN2CCC(C(C2)OC)NC(=O)C3=CC(=C(C=C3OC)N)Cl.O

InChI

InChI=1S/C23H31ClN4O4.H2O/c1-15-5-6-16(13-26-15)32-10-4-8-28-9-7-20(22(14-28)31-3)27-23(29)17-11-18(24)19(25)12-21(17)30-2;/h5-6,11-13,20,22H,4,7-10,14,25H2,1-3H3,(H,27,29);1H2