ethanoic acid; 2-propan-2-ylquinoline; 1-(1-propoxyethoxy)ethylbenzene

Systemtic Name: ethanoic acid; 2-propan-2-ylquinoline; 1-(1-propoxyethoxy)ethylbenzene Openeye Name: acetic acid; 2-isopropylquinoline; 1-(1-propoxyethoxy)ethylbenzene CAS Name: acetic acid; 2-propan-2-ylquinoline; 1-(1-propoxyethoxy)ethylbenzene IUPAC Name: acetic acid; 2-propan-2-ylquinoline; 1-(1-propoxyethoxy)ethylbenzene Traditional Name: acetic acid; 2-isopropylquinoline; 1-(1-propoxyethoxy)ethylbenzene Formula: C27H37NO4 MolecularWeight: 439.58698

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C)OC(C)C1=CC=CC=C1.CC(C)C1=NC2=CC=CC=C2C=C1.CC(=O)O

Isomeric SMILES

CCCOC(C)OC(C)C1=CC=CC=C1.CC(C)C1=NC2=CC=CC=C2C=C1.CC(=O)O

InChI

InChI=1S/C13H20O2.C12H13N.C2H4O2/c1-4-10-14-12(3)15-11(2)13-8-6-5-7-9-13;1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;1-2(3)4/h5-9,11-12H,4,10H2,1-3H3;3-9H,1-2H3;1H3,(H,3,4)