3-[6-methoxy-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-chromen-3-yl]phenol

Systemtic Name: 3-[6-methoxy-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-chromen-3-yl]phenol Openeye Name: 3-[6-methoxy-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]chroman-3-yl]phenol CAS Name: 3-[6-methoxy-4-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-3,4-dihydro-2H-1-benzopyran-3-yl]phenol IUPAC Name: 3-[6-methoxy-4-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3,4-dihydro-2H-chromen-3-yl]phenol Traditional Name: 3-[6-methoxy-4-[4-(2-pyrrolidinoethoxy)phenyl]chroman-3-yl]phenol Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCC(C2C3=CC=C(C=C3)OCCN4CCCC4)C5=CC(=CC=C5)O

Isomeric SMILES

COC1=CC2=C(C=C1)OCC(C2C3=CC=C(C=C3)OCCN4CCCC4)C5=CC(=CC=C5)O

InChI

InChI=1S/C28H31NO4/c1-31-24-11-12-27-25(18-24)28(26(19-33-27)21-5-4-6-22(30)17-21)20-7-9-23(10-8-20)32-16-15-29-13-2-3-14-29/h4-12,17-18,26,28,30H,2-3,13-16,19H2,1H3