1-[5-methoxy-2-[(3-methylbutylamino)methyl]phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol

Systemtic Name: 1-[5-methoxy-2-[(3-methylbutylamino)methyl]phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol Openeye Name: 1-[2-[(isopentylamino)methyl]-5-methoxy-phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol CAS Name: 1-[5-methoxy-2-[(3-methylbutylamino)methyl]phenoxy]-3-(4-methyl-1-piperazinyl)-2-propanol IUPAC Name: 1-[5-methoxy-2-[(3-methylbutylamino)methyl]phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol Traditional Name: 1-[2-[(isoamylamino)methyl]-5-methoxy-phenoxy]-3-(4-methylpiperazino)propan-2-ol Formula: C21H37N3O3 MolecularWeight: 379.53678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNCC1=C(C=C(C=C1)OC)OCC(CN2CCN(CC2)C)O

Isomeric SMILES

CC(C)CCNCC1=C(C=C(C=C1)OC)OCC(CN2CCN(CC2)C)O

InChI

InChI=1S/C21H37N3O3/c1-17(2)7-8-22-14-18-5-6-20(26-4)13-21(18)27-16-19(25)15-24-11-9-23(3)10-12-24/h5-6,13,17,19,22,25H,7-12,14-16H2,1-4H3